2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide

C18H21N3O2 — CID 109094402

IUPAC2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
SMILESCC(C)CNC(=O)c1cccc(C(=O)NCc2ccccc2)n1
InChIInChI=1S/C18H21N3O2/c1-13(2)11-19-17(22)15-9-6-10-16(21-15)18(23)20-12-14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyWWYIIJCNBNLEQK-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.40
Rot. Bonds6

About 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide

2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide (PubChem CID 109094402) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
PubChem CID109094402
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC Name2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
SMILESCC(C)CNC(=O)c1cccc(C(=O)NCc2ccccc2)n1
InChIInChI=1S/C18H21N3O2/c1-13(2)11-19-17(22)15-9-6-10-16(21-15)18(23)20-12-14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyWWYIIJCNBNLEQK-UHFFFAOYSA-N
XLogP2.40
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-[(4-chlorophenyl)methyl]-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094411
2-N-(2-methylpropyl)-6-N-phenylpyridine-2,6-dicarboxamide
CID 109094464
2-N-[(2-chlorophenyl)methyl]-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094410
2-N-benzyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097211
6-amino-N-benzylpyridine-2-carboxamide
CID 62240949
2-N-benzyl-6-N-(4-methylphenyl)pyridine-2,6-dicarboxamide
CID 109097257
6-[[2-(2-methylpropylamino)-2-oxoethyl]carbamoyl]pyridine-2-carboxylic acid
CID 115730327
2-N-(2-methylpropyl)-6-N-(2-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109094481
methyl 4-[[6-(benzylcarbamoyl)pyridine-2-carbonyl]amino]benzoate
CID 109097311
N-benzyl-6-(chloromethyl)pyridine-2-carboxamide
CID 67806614
2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109097324
6-N-(4-chlorophenyl)-2-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094492

Frequently Asked Questions

What is the IUPAC name of 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide (CID 109094402) is 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide is CC(C)CNC(=O)c1cccc(C(=O)NCc2ccccc2)n1.
What is the InChIKey of 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide?
The InChIKey is WWYIIJCNBNLEQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-13(2)11-19-17(22)15-9-6-10-16(21-15)18(23)20-12-14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide?
2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide has a molecular weight of 311.38 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109094402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).